28-[2-azanylethyl-(28-oxidanyl-28-oxidanylidene-octacosyl)amino]octacosanoic acid

Systemtic Name: 28-[2-azanylethyl-(28-oxidanyl-28-oxidanylidene-octacosyl)amino]octacosanoic acid Openeye Name: 28-[2-aminoethyl-(28-hydroxy-28-oxo-octacosyl)amino]octacosanoic acid CAS Name: 28-[2-aminoethyl-(28-hydroxy-28-oxooctacosyl)amino]octacosanoic acid IUPAC Name: 28-[2-aminoethyl-(28-hydroxy-28-oxooctacosyl)amino]octacosanoic acid Traditional Name: 28-[2-aminoethyl-(28-hydroxy-28-keto-octacosyl)amino]montanic acid Formula: C58H116N2O4 MolecularWeight: 905.55264

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCCCCCCCCCCCC(=O)O)CCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O)CCN

Isomeric SMILES

C(CCCCCCCCCCCCCC(=O)O)CCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O)CCN

InChI

InChI=1S/C58H116N2O4/c59-53-56-60(54-49-45-41-37-33-29-25-21-17-13-9-5-1-3-7-11-15-19-23-27-31-35-39-43-47-51-57(61)62)55-50-46-42-38-34-30-26-22-18-14-10-6-2-4-8-12-16-20-24-28-32-36-40-44-48-52-58(63)64/h1-56,59H2,(H,61,62)(H,63,64)